ChemSpider 2D Image | (~2~H_3_)Methyl (2R)-2-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenoxy)propanoate | C16H10D3ClF3NO4

(2H3)Methyl (2R)-2-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenoxy)propanoate

  • Molecular FormulaC16H10D3ClF3NO4
  • Average mass378.745 Da
  • Monoisotopic mass378.067352 Da
  • ChemSpider ID103835467

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2H3)Methyl (2R)-2-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenoxy)propanoate [ACD/IUPAC Name]
(2H3)Methyl-(2R)-2-(4-{[3-chlor-5-(trifluormethyl)-2-pyridinyl]oxy}phenoxy)propanoat [German] [ACD/IUPAC Name]
(2R)-2-(4-{[3-Chloro-5-(trifluorométhyl)-2-pyridinyl]oxy}phénoxy)propanoate de (2H3)méthyle [French] [ACD/IUPAC Name]
Propanoic acid, 2-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]-, methyl-d3 ester, (2R)- [ACD/Index Name]
Haloxyfop-R-methyl D3 (methoxy D3)
trideuteriomethyl (2R)-2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 390.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.0±3.0 kJ/mol
Flash Point: 190.2±27.9 °C
Index of Refraction: 1.513
Molar Refractivity: 83.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 545.39
ACD/KOC (pH 5.5): 3166.20
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 545.39
ACD/KOC (pH 7.4): 3166.20
Polar Surface Area: 58 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 276.1±3.0 cm3

Click to predict properties on the Chemicalize site


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